Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 4/20 | 0.41 |
| ▸ | BCR | P11274 | 3/20 | 0.41 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | P2RY1 | P47900 | 2/20 | 0.39 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL19666713 | 0.77 | ABL1 (0.39) | ABL1BCRCHRNA7P2RX3MEN1 | |
| SCHEMBL20553560 | 0.67 | ABL1 (0.45) | ABL1BCRCHRNA7MAPTSMN1; SMN2 | |
| SCHEMBL11125111 | 0.63 | CTSC (0.56) | MAPTMEN1RAB9AKMT2AEPHX2 | |
| SCHEMBL1923201 | 0.63 | MAPT (0.61) | ABL1BCRCHRNA7MAPTMEN1 | |
| SCHEMBL3194551 | 0.63 | MAPT (0.61) | ABL1BCRCHRNA7MAPTMEN1 | |
| SCHEMBL20552403 | 0.63 | DHODH (0.49) | ABL1BCRMAPTDHODH | |
| SCHEMBL1923203 | 0.62 | MAPT (0.53) | ABL1BCRP2RY1MAPTMEN1 | |
| SCHEMBL5452795 | 0.61 | MAPT (0.51) | ABL1BCRP2RX3MAPTMEN1 | |
| SCHEMBL6289309 | 0.61 | MAPT (0.55) | MAPTMEN1RAB9AKMT2AEPHX2 | |
| SCHEMBL3919027 | 0.61 | MAPT (0.59) | P2RY1MAPTEPHX2GAAKDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104327084-B | The small molecule myristate inhibitors and its application method of BCR ABL | 达那-法伯癌症研究所 | 2017-06-06 | — | — | CN | claimed |
| CN-104327084-B | The small molecule myristate inhibitors and its application method of BCR ABL | 达那-法伯癌症研究所 | 2017-06-06 | — | — | CN | disclosed |